Compound Detail
CHEMBL5287963
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Basic Information
| ChEMBL ID | CHEMBL5287963 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | QMTHZTQFLVXPBR-BUFQOAPZSA-N |
| Parent Compound | CHEMBL5315304 |
| Active Moiety | CHEMBL5315304 |
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names
Molecular Properties
327.4
MW (Da)
4.08
ALogP
5
HBA
2
HBD
105.1
PSA (Ų)
0.43
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 3 meas. best 5.7
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Sentrin-specific protease 3 CHEMBL5291568 | IC50 | 5.7 | 5.7 | 2000.0 | 1 |
| Sentrin-specific protease 1 CHEMBL1909484 | IC50 | 5.62 | 5.62 | 2400.0 | 1 |
| Sentrin-specific protease 2 CHEMBL2176776 | IC50 | 5.6 | 5.6 | 2500.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Sentrin-specific protease 3 | IC50 | = | 2000.0 | nM | 5.7 | Inhibition of SENP3 (unknown origin) | 35939992 |
| Sentrin-specific protease 1 | IC50 | = | 2400.0 | nM | 5.62 | Inhibition of SENP1 (unknown origin) | 35939992 |
| Sentrin-specific protease 2 | IC50 | = | 2500.0 | nM | 5.6 | Inhibition of SENP2 (unknown origin) | 35939992 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 35939992 | 10.1016/j.ejmech.2022.114650 | Sentrin-specific protease 1 | 1 |
| 35939992 | 10.1016/j.ejmech.2022.114650 | Sentrin-specific protease 2 | 1 |
| 35939992 | 10.1016/j.ejmech.2022.114650 | Sentrin-specific protease 3 | 1 |
Data from ChEMBL 36 via Core Engine